Home Nitriles 3-(2-Chloro-5-methylphenyl)benzonitrile

3-(2-Chloro-5-methylphenyl)benzonitrile

CAS No.:
1365272-10-1
Catalog Number:
AG0011ZN
Molecular Formula:
C14H10ClN
Molecular Weight:
227.6889
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
10g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0011ZN
Chemical Name:
3-(2-Chloro-5-methylphenyl)benzonitrile
CAS Number:
1365272-10-1
Molecular Formula:
C14H10ClN
Molecular Weight:
227.6889
MDL Number:
MFCD21609623
IUPAC Name:
3-(2-chloro-5-methylphenyl)benzonitrile
InChI:
InChI=1S/C14H10ClN/c1-10-5-6-14(15)13(7-10)12-4-2-3-11(8-12)9-16/h2-8H,1H3
InChI Key:
QQBHRDQAVTUTHL-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cc(C)ccc1Cl
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.05g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.691g/mol
Monoisotopic Mass:
227.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties